| Authors: | Hung, Linda and Carter, Emily A. |
| Title: | Accurate simulations of metals at the mesoscale: Explicit treatment of 1 million atoms with quantum mechanics |
| Journal: | CHEMICAL PHYSICS LETTERS |
| Year: | 2009 |
| Vol.: | 475 |
| No.: | 4-6 |
| pp.: | 163-170 |
| Authors: | Garcia-Cervera, C. J. and Lu, Jianfeng and Xuan, Yulin and E, Weinan |
| Title: | Linear-scaling subspace-iteration algorithm with optimally localized nonorthogonal wave functions for Kohn-Sham density functional theory |
| Journal: | PHYSICAL REVIEW B |
| Year: | 2009 |
| Vol.: | 79 |
| No.: | 11 |
| Authors: | Chen, Huajie and Zhou, Aihui |
| Title: | Orbital-Free Density Functional Theory for Molecular Structure Calculations |
| Journal: | NUMERICAL MATHEMATICS-THEORY METHODS AND APPLICATIONS |
| Year: | 2008 |
| Vol.: | 1 |
| No.: | 1 |
| pp.: | 1-28 |
| Authors: | Ho, Gregory S. and Ligneres, Vincent L. and Carter, Emily A. |
| Title: | Introducing PROFESS: A new program for orbital-free density functional theory calculations |
| Journal: | COMPUTER PHYSICS COMMUNICATIONS |
| Year: | 2008 |
| Vol.: | 179 |
| No.: | 11 |
| pp.: | 839-854 |
| Authors: | Ho, Gregory S. and Ligneres, Vincent L. and Carter, Emily A. |
| Title: | Analytic form for a nonlocal kinetic energy functional with a density-dependent kernel for orbital-free density functional theory under periodic and Dirichlet boundary conditions |
| Journal: | PHYSICAL REVIEW B |
| Year: | 2008 |
| Vol.: | 78 |
| No.: | 4 |
| Authors: | Garcia-Cervera, Carlos J. |
| Title: | A remark on ``An efficient real space method for orbital-free density-functional theory{''} |
| Journal: | COMMUNICATIONS IN COMPUTATIONAL PHYSICS |
| Year: | 2008 |
| Vol.: | 3 |
| No.: | 4 |
| pp.: | 968-972 |
| Authors: | Garcia-Cervera, Carlos J. and Lu, Jianfeng and Weinan, E. |
| Title: | A sub-linear scaling algorithm for computing the electronic structure of materials |
| Journal: | COMMUNICATIONS IN MATHEMATICAL SCIENCES |
| Year: | 2007 |
| Vol.: | 5 |
| No.: | 4 |
| pp.: | 999-1026 |
| Authors: | E, Weinan and Lu, Jianfeng |
| Title: | The continuum limit and QM-continuum approximation of quantum mechanical models of solids |
| Journal: | COMMUNICATIONS IN MATHEMATICAL SCIENCES |
| Year: | 2007 |
| Vol.: | 5 |
| No.: | 3 |
| pp.: | 679-696 |